Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-106714
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Te', 'Mo', 'Se']
  • Chemical System: Mo-Se-Te
  • Density: 7.098646579818714
  • Atomic Density: 0.04239575099894284
  • Unit Cell Volume: 141.5236163678198
  • Molar Volume: 14.20458564385418
  • Full Formula: Te2 Mo2 Se2
  • Reduced Formula: TeMoSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1